5,5-Dimethyl-2-((5-(3-nitrophenyl)-2-furyl)methylene)-1,3-cyclohexanedione
TL;DR: 5,5-Dimethyl-2-((5-(3-nitrophenyl)-2-furyl)methylene)-1,3-cyclohexanedione (CAS 392318-81-9) is a chemical compound with molecular formula C19H17NO5 and molecular weight 339.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-dimethyl-2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]cyclohexane-1,3-dione
Also Known As: 5,5-Dimethyl-2-((5-(3-nitrophenyl)furan-2-yl)methylene)cyclohexane-1,3-dione, 5,5-dimethyl-2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]cyclohexane-1,3-dione, 5,5-DIMETHYL-2-((5-(3-NITROPHENYL)-2-FURYL)METHYLENE)-1,3-CYCLOHEXANEDIONE, 5,5-dimethyl-2-{[5-(3-nitrophenyl)furan-2-yl]methylidene}cyclohexane-1,3-dione, 632-263-8
| Molecular Formula | C19H17NO5 |
|---|---|
| Molecular Weight | 339.11 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 339.1107 |
| Heavy Atoms | 25 |
| Complexity | 581.0 |
Chemical Identifiers
| CAS Number | 392318-81-9 |
|---|---|
| SMILES | CC1(CC(=O)C(=CC2=CC=C(O2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C1)C |
| InChIKey | NKJXNWAALQLSRS-UHFFFAOYSA-N |
Product Overview
5,5-Dimethyl-2-((5-(3-nitrophenyl)-2-furyl)methylene)-1,3-cyclohexanedione (CAS 392318-81-9), with molecular formula C19H17NO5 and molecular weight 339.11 g/mol. IUPAC: 5,5-dimethyl-2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]cyclohexane-1,3-dione.
Chemical Property Profile of 5,5-Dimethyl-2-((5-(3-nitrophenyl)-2-furyl)methylene)-1,3-cyclohexanedione
Property Insights of 5,5-Dimethyl-2-((5-(3-nitrophenyl)-2-furyl)methylene)-1,3-cyclohexanedione
The XLogP value of 3.5 indicates that 5,5-Dimethyl-2-((5-(3-nitrophenyl)-2-furyl)methylene)-1,3-cyclohexanedione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,5-Dimethyl-2-((5-(3-nitrophenyl)-2-furyl)methylene)-1,3-cyclohexanedione. Following Lipinski's Rule of Five, 5,5-Dimethyl-2-((5-(3-nitrophenyl)-2-furyl)methylene)-1,3-cyclohexanedione has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5,5-Dimethyl-2-((5-(3-nitrophenyl)-2-furyl)methylene)-1,3-cyclohexanedione?
The CAS number of 5,5-Dimethyl-2-((5-(3-nitrophenyl)-2-furyl)methylene)-1,3-cyclohexanedione is 392318-81-9.
What is the molecular formula of 5,5-Dimethyl-2-((5-(3-nitrophenyl)-2-furyl)methylene)-1,3-cyclohexanedione?
The molecular formula of 5,5-Dimethyl-2-((5-(3-nitrophenyl)-2-furyl)methylene)-1,3-cyclohexanedione is C19H17NO5.
What is the molecular weight of 5,5-Dimethyl-2-((5-(3-nitrophenyl)-2-furyl)methylene)-1,3-cyclohexanedione?
The molecular weight of 5,5-Dimethyl-2-((5-(3-nitrophenyl)-2-furyl)methylene)-1,3-cyclohexanedione is 339.11 g/mol.
Where can I buy 5,5-Dimethyl-2-((5-(3-nitrophenyl)-2-furyl)methylene)-1,3-cyclohexanedione?
You can request a quote for 5,5-Dimethyl-2-((5-(3-nitrophenyl)-2-furyl)methylene)-1,3-cyclohexanedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5-Dimethyl-2-((5-(3-nitrophenyl)-2-furyl)methylene)-1,3-cyclohexanedione?
Yes, KEHONG BIO provides custom synthesis services for 5,5-Dimethyl-2-((5-(3-nitrophenyl)-2-furyl)methylene)-1,3-cyclohexanedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.